HC Blue No. 16

Details

Stereochemistry	ACHIRAL
Molecular Formula	C23H30N3O2.Br
Molecular Weight	460.407
Optical Activity	NONE
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Br-].CCC[N+](C)(C)CCCNC1=C2C(=O)C3=C(C=CC=C3)C(=O)C2=C(NC)C=C1

InChI

InChIKey=HAECXVUPWKTFLJ-UHFFFAOYSA-N

InChI=1S/C23H29N3O2.BrH/c1-5-14-26(3,4)15-8-13-25-19-12-11-18(24-2)20-21(19)23(28)17-10-7-6-9-16(17)22(20)27;/h6-7,9-12H,5,8,13-15H2,1-4H3,(H-,24,25,27,28);1H

HIDE SMILES / InChI

Molecular Formula	Br
Molecular Weight	79.904
Charge	-1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C23H30N3O2
Molecular Weight	380.5032
Charge	1
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	NONE

Approval Year

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 20:50:01 GMT 2025` Edited by `admin` on `Mon Mar 31 20:50:01 GMT 2025`
Record UNII	6A8OGM5UU7
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

HC Blue No. 16

Official Name

English

1-Propanaminium, 3-[[9,10-dihydro-4-(methylamino)-9,10-dioxo-1-anthracenyl]amino]-N,N-dimethyl-N-propyl-, bromide

Preferred Name

English

1-Propanaminium, 3-[[9,10-dihydro-4-(methylamino)-9,10-dioxo-1-anthracenyl]amino]-N,N-dimethyl-N-propyl-, bromide (1:1)

Systematic Name

English

HC Blue 16

Common Name

English

Code System Code Type Description

CAS

502453-61-4

Created by admin on Mon Mar 31 20:50:01 GMT 2025 , Edited by admin on Mon Mar 31 20:50:01 GMT 2025

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FDA UNII

6A8OGM5UU7

Created by admin on Mon Mar 31 20:50:01 GMT 2025 , Edited by admin on Mon Mar 31 20:50:01 GMT 2025

PRIMARY

PUBCHEM

12011964

Created by admin on Mon Mar 31 20:50:01 GMT 2025 , Edited by admin on Mon Mar 31 20:50:01 GMT 2025

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EPA CompTox

DTXSID50198249

Created by admin on Mon Mar 31 20:50:01 GMT 2025 , Edited by admin on Mon Mar 31 20:50:01 GMT 2025

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Related Record Type Details


					25L4X4NE42

Dimethyl-[3-[[4-(methylamino)-9,10-dioxoanthracen-1-yl]amino]propyl]-propylazanium

PARENT -> SALT/SOLVATE

Amount: